5-((4-[(3-METHYLBUTANOYL)AMINO]PHENYL)AMINO)-5-OXOPENTANOIC ACID

pro_cas
940214-39-1
pro_cdbregno
CCD00744312
pro_formula
C16 H22 N2 O4
pro_molWeight
306.36

basic_info

Product_Name: 5-((4-[(3-METHYLBUTANOYL)AMINO]PHENYL)AMINO)-5-OXOPENTANOIC ACID
CAS: 940214-39-1
EnglishSynonyms: 5-((4-[(3-METHYLBUTANOYL)AMINO]PHENYL)AMINO)-5-OXOPENTANOIC ACID ; PENTANOIC ACID, 5-[[4-[(3-METHYL-1-OXOBUTYL)AMINO]PHENYL]AMINO]-5-OXO- ; 4-([4-(3-METHYLBUTANAMIDO)PHENYL]CARBAMOYL)BUTANOIC ACID ; 5-(4-[(3-METHYLBUTANOYL)AMINO]ANILINO)-5-OXOPENTANOIC ACID
pro_mdlNumber: MFCD09434160
pro_acceptors: 6
pro_donors: 3
pro_smile: CC(C)CC(=O)Nc1ccc(cc1)NC(=O)CCCC(=O)O
InChi: InChI=1S/C16H22N2O4/c1-11(2)10-15(20)18-13-8-6-12(7-9-13)17-14(19)4-3-5-16(21)22/h6-9,11H,3-5,10H2,1-2H3,(H,17,19)(H,18,20)(H,21,22)
InChiKey: InChIKey=LUVWGZIGZLLECO-UHFFFAOYSA-N

property

Comments: WARNINGS: IRRITANT

secure_info

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